Vitas-M small molecule compound
2-methylpropyl 4-[4-(acetyloxy)phenyl]-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402855
SMILES CC(COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)OC(=O)C)C(=O)CC(C2)c1cccs1)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H29NO5S MW 479.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO5S/c1-15(2)14-32-27(31)24-16(3)28-21-12-19(23-6-5-11-34-23)13-22(30)26(21)25(24)18-7-9-20(10-8-18)33-17(4)29/h5-11,15,19,25,28H,12-14H2,1-4H3InChIKey
XQBYPMQSPADUCF-UHFFFAOYSA-NSynonyms
2methylpropyl4(4(acetyloxy)phenyl)2methyl5oxo7(thiophen2yl)145678hexahydroquinoline3carboxylate
2methylpropyl4(4acetyloxyphenyl)2methyl5oxo7thiophen2yl4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=CC=C(C=C4)OC(=O)C)C(=O)OCC(C)C
InChI=1SC27H29NO5Sc115(2)143227(31)2416(3)28211219(2365113423)1322(30)26(21)25(24)187920(10818)3317(4)29h51115192528H1214H214H3
MFCD03370914
ZINC000000781278
ZINC000000781281
Check stock
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Check stock on Vitas-MAvailable files
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